![4-[(2'-Methylene-3',5'-dihydroxycyclohexylidene)ethylidene]-1-[1",5"-dimethyl-5"-hydroxy-4"-((benzoylamino)hexyl]-7a-methyl-(perhydro)indane](/api/spectrum/KCLFoqmM15D/structure.png?h=300&w=458 "4-[(2'-Methylene-3',5'-dihydroxycyclohexylidene)ethylidene]-1-[1\",5\"-dimethyl-5\"-hydroxy-4\"-((benzoylamino)hexyl]-7a-methyl-(perhydro)indane")
| SpectraBase Compound ID | E19u5DQxPSA |
|---|---|
| InChI | InChI=1S/C34H49NO4/c1-22(13-18-31(33(3,4)39)35-32(38)25-10-7-6-8-11-25)28-16-17-29-24(12-9-19-34(28,29)5)14-15-26-20-27(36)21-30(37)23(26)2/h6-8,10-11,14-15,22,27-31,36-37,39H,2,9,12-13,16-21H2,1,3-5H3,(H,35,38)/b24-14+,26-15- |
| InChIKey | ASPWUVNESJVJSZ-NQVFUGGRSA-N |
| Mol Weight | 535.8 g/mol |
| Molecular Formula | C34H49NO4 |
| Exact Mass | 535.366159 g/mol |
Mass Spectrum (GC)
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | KCLFoqmM15D |
|---|---|
| Name | 4-[(2'-Methylene-3',5'-dihydroxycyclohexylidene)ethylidene]-1-[1",5"-dimethyl-5"-hydroxy-4"-((benzoylamino)hexyl]-7a-methyl-(perhydro)indane |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C34H49NO4 |
| InChI | InChI=1S/C34H49NO4/c1-22(13-18-31(33(3,4)39)35-32(38)25-10-7-6-8-11-25)28-16-17-29-24(12-9-19-34(28,29)5)14-15-26-20-27(36)21-30(37)23(26)2/h6-8,10-11,14-15,22,27-31,36-37,39H,2,9,12-13,16-21H2,1,3-5H3,(H,35,38)/b24-14+,26-15- |
| InChIKey | ASPWUVNESJVJSZ-NQVFUGGRSA-N |
| Molecular Weight | 535.769 g/mol |
| SMILES | OC1C(\C(=C/C=C/2C3C(C(C(CCC(C(O)(C)C)NC(=O)c4ccccc4)C)CC3)(CCC2)C)CC(C1)O)=C |
| SPLASH | splash10-0a4i-0900010000-649d9eb25ecd7479fc71 |
| Source of Spectrum | D1-2002-722-16 |
| Wiley ID | 1548042 |